Vitas-M small molecule compound
butane-1,4-diyl bis[2-methyl-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate]
Catalog ID
STK063355
SMILES Cc1ccc(o1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(o1)C)C(=O)CCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C36H40N2O8 MW 628.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H40N2O8/c1-19-13-15-27(45-19)33-29(21(3)37-23-9-7-11-25(39)31(23)33)35(41)43-17-5-6-18-44-36(42)30-22(4)38-24-10-8-12-26(40)32(24)34(30)28-16-14-20(2)46-28/h13-16,33-34,37-38H,5-12,17-18H2,1-4H3InChIKey
XVRSLDQEWCQUQH-UHFFFAOYSA-NSynonyms
4(2methyl4(5methylfuran2yl)5oxo4678tetrahydro1Hquinoline3carbonyl)oxybutyl2methyl4(5methylfuran2yl)5oxo4678tetrahydro1Hquinoline3carboxylate
butane14diylbis(2methyl4(5methylfuran2yl)5oxo145678hexahydroquinoline3carboxylate)
CC1=CC=C(O1)C2C3=C(CCCC3=O)NC(=C2C(=O)OCCCCOC(=O)C4=C(NC5=C(C4C6=CC=C(O6)C)C(=O)CCC5)C)C
Cc1ccc(o1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OCCCCOC(=O)C1=C(C)NC2=C(C1c1ccc(o1)C)C(=O)CCC2
InChI=1SC36H40N2O8c119131527(4519)3329(21(3)3723971125(39)31(23)33)35(41)431756184436(42)3022(4)38241081226(40)32(24)34(30)28161420(2)4628h131633343738H5121718H214H3
MFCD03312496
STK063355
ZINC000033354185
ZINC000033354201
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.